Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL510650

ECHINOMYCIN
Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CS[C@H]1SC[C@H]2C(=O)N(C)[C@@H](C(C)C)C(=O)OC[C@@H](NC(=O)c3cnc4ccccc4n3)C(=O)N[C@@H](C)C(=O)N(C)[C@@H]1C(=O)N(C)[C@@H](C(C)C)C(=O)OC[C@@H](NC(=O)c1cnc3ccccc3n1)C(=O)N[C@@H](C)C(=O)N2C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL510650
Name ECHINOMYCIN
Phase Preclinical
Structure Type MOL
InChI Key AUJXLBOHYWTPFV-VLNMHYLBSA-N
3
Targets
4
Activities
2
Assay Types
0
PK Parameters
20
Publications
0
Known Names

Molecular Properties

1101.3
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C51H64N12O12S2
MW 1101.28

Activity Summary

EC50 3 meas. best 8.92
IC50 1 meas. best 6.3

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Nucleic Acid
CHEMBL345
 EC50 8.92 8.92 1.2 1
Plasmodium falciparum
CHEMBL364
 EC50 7.13 6.705 73.7 2
CCRF-CEM
CHEMBL382
 IC50 6.3 6.3 500.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Nucleic Acid EC50 = 1.2 nM 8.92 Binding affinity to HIF-1 5'-CGTG-3' DNA sequence in human U251 cells assessed a... 22305612
Plasmodium falciparum EC50 = 73.7 nM 7.13 NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferati... 18579783
CCRF-CEM IC50 = 500.0 nM 6.3 Cytotoxicity in human leukemic CCRF-CEM cells. 14667232
Plasmodium falciparum EC50 = 524.0 nM 6.28 NOVARTIS: Inhibition of Plasmodium falciparum W2 (drug-resistant) proliferation ... 18579783

Literature References

PubMed DOI Target Context # Activities
19185486 10.1016/j.bmcl.2009.01.010 Staphylococcus aureus 19
15646539 10.1016/s0399-8320(04)95062-2 Unchecked 11
15646539 10.1016/s0399-8320(04)95062-2 NON-PROTEIN TARGET 8
19185486 10.1016/j.bmcl.2009.01.010 Enterococcus faecalis 7
9871531 10.1016/s0960-894x(98)00113-9 P388 6
9871531 10.1016/s0960-894x(98)00113-9 B16 6
24900772 10.1021/ml400323x Unchecked 3
21195622 10.1016/j.bmc.2010.12.009 Calf thymus DNA 2
18579783 10.1073/pnas.0802982105 Plasmodium falciparum 2
14698199 10.1016/j.bmcl.2003.09.086 HT-29 2
14987067 10.1021/np030397v Plasmodium falciparum 1
23062825 10.1016/j.bmc.2012.09.040 Acetylcholinesterase 1
18579783 10.1073/pnas.0802982105 Huh-7 1
19185486 10.1016/j.bmcl.2009.01.010 HCT-116 1
14987067 10.1021/np030397v Bacillus anthracis 1
18327911 10.1021/np700738k P388 1
14667232 10.1021/jm030253d CCRF-CEM 1
9871531 10.1016/s0960-894x(98)00113-9 SNU-16 1
14698199 10.1016/j.bmcl.2003.09.086 B16 1
14698199 10.1016/j.bmcl.2003.09.086 BeWo 1

Data from ChEMBL 36 via Core Engine